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Structure paper

TitleDesign and synthesis of orally bioavailable serum and glucocorticoid-regulated kinase 1 (SGK1) inhibitors.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 19, Page 4441-4445, Year 2009
Publish dateMay 7, 2009 (structure data deposition date)
AuthorsHammond, M. / Washburn, D.G. / Hoang, H.T. / Manns, S. / Frazee, J.S. / Nakamura, H. / Patterson, J.R. / Trizna, W. / Wu, C. / Azzarano, L.M. ...Hammond, M. / Washburn, D.G. / Hoang, H.T. / Manns, S. / Frazee, J.S. / Nakamura, H. / Patterson, J.R. / Trizna, W. / Wu, C. / Azzarano, L.M. / Nagilla, R. / Nord, M. / Trejo, R. / Head, M.S. / Zhao, B. / Smallwood, A.M. / Hightower, K. / Laping, N.J. / Schnackenberg, C.G. / Thompson, S.K.
External linksBioorg. Med. Chem. Lett. / PubMed:19497745
MethodsX-ray diffraction
Resolution2.6 - 3.1 Å
Structure data

PDB-3hdm:
Crystal structure of serum and glucocorticoid-regulated kinase 1 in complex with compound 1
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

PDB-3hdn:
Crystal structure of serum and glucocorticoid-regulated kinase 1 in complex with compound 2
Method: X-RAY DIFFRACTION / Resolution: 3.1 Å

Chemicals

ChemComp-MMG:
4-(5-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzoic acid

ChemComp-HOH:
WATER

ChemComp-GMG:
[4-(5-naphthalen-2-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)phenyl]acetic acid

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / AGC PROTEIN KINASE / APOPTOSIS / ATP-BINDING / ENDOPLASMIC RETICULUM / NUCLEOTIDE-BINDING / NUCLEUS / PHOSPHORYLATION / SERINE/THREONINE-PROTEIN KINASE / Kinase / Phosphoprotein

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